4-[(1-methylquinolin-1-ium-4-yl)methylideneamino]benzoic acid

Systemtic Name: 4-[(1-methylquinolin-1-ium-4-yl)methylideneamino]benzoic acid Openeye Name: 4-[(1-methylquinolin-1-ium-4-yl)methyleneamino]benzoic acid CAS Name: 4-[(1-methyl-4-quinolin-1-iumyl)methylideneamino]benzoic acid IUPAC Name: 4-[(1-methylquinolin-1-ium-4-yl)methylideneamino]benzoic acid Traditional Name: 4-[(1-methylquinolin-1-ium-4-yl)methyleneamino]benzoic acid Formula: C18H15N2O2+ MolecularWeight: 291.3239

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C2=CC=CC=C21)C=NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C[N+]1=CC=C(C2=CC=CC=C21)C=NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H14N2O2/c1-20-11-10-14(16-4-2-3-5-17(16)20)12-19-15-8-6-13(7-9-15)18(21)22/h2-12H,1H3/p+1